Information card for entry 1572744

Structure parameters

• Formula: C62 H72 Au2 B2 Cl12 F8 N8
• Calculated formula: C62 H72 Au2 B2 Cl12 F8 N8
• Title of publication: CCC–NHC Au(III) Pincer Complexes as a Reliable Platform for Isolating Elusive Species
• Authors of publication: Valdés, Hugo; Alpuente, Nora; Salvador Sedano, Pedro; Hashmi, Stephen; Ribas, Xavi
• Journal of publication: Chemical Science
• Year of publication: 2024
• a: 10.54 ± 0.0013 Å
• b: 13.2869 ± 0.0019 Å
• c: 13.5269 ± 0.0018 Å
• α: 87.44 ± 0.004°
• β: 88.406 ± 0.004°
• γ: 74.202 ± 0.004°
• Cell volume: 1820.7 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0562
• Residual factor for significantly intense reflections: 0.0417
• Weighted residual factors for significantly intense reflections: 0.0946
• Weighted residual factors for all reflections included in the refinement: 0.1025
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No